SCHEMBL26603095

SCHEMBL26603095

FC(F)c1cc(Br)c2cn[nH]c2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 4/20 0.37
▸ METAP2 P50579 3/20 0.37
▸ AXL P30530 2/20 0.37
▸ CSNK2A1 P68400 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ PTPN6 P29350 1/20 0.36
▸ IDO1 P14902 1/20 0.35
▸ TDO2 P48775 1/20 0.35
▸ TGFBR1 P36897 1/20 0.34
▸ TRPA1 O75762 2/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CHEK1 O14757 1/20 0.32
▸ ADORA2A P29274 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ RET P07949 1/20 0.31
▸ PI4KA P42356 1/20 0.31
▸ XDH P47989 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29514216 1.00 NOS1 (0.37) NOS1METAP2AXLCSNK2A1DYRK1A
SCHEMBL26665412 0.76 TRPA1 (0.38) METAP2AXLTGFBR1TRPA1SMN1; SMN2
SCHEMBL30509508 0.73 ALDH1A1 (0.40) NOS1METAP2AXLCSNK2A1DYRK1A
SCHEMBL25322760 0.73 ALDH1A1 (0.40) NOS1METAP2AXLCSNK2A1DYRK1A
SCHEMBL31555833 0.73 PLK4 (0.41) NOS1METAP2AXLCSNK2A1DYRK1A
SCHEMBL20656567 0.66 ALDH1A1 (0.39) IDO1TRPA1SMN1; SMN2ALDH1A1CHEK1
SCHEMBL15016943 0.66 PLK4 (0.38) NOS1DYRK1ATRPA1SMN1; SMN2ALDH1A1
SCHEMBL22805932 0.64 NOS1 (0.36) NOS1METAP2AXLPTPN6IDO1
SCHEMBL29366774 0.64 NOS1 (0.36) NOS1METAP2AXLPTPN6IDO1
SCHEMBL2668441 0.63 NOS1 (0.46) NOS1METAP2AXLCSNK2A1DYRK1A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339900-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-10-26 — — US disclosed
CN-116171280-A Casein kinase 1 delta modulators 詹森药业有限公司 2023-05-26 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230339900-A1 CASEIN KINASE 1 DELTA MODULATORS CSNK1D, CSNK1A1, CSNK2A1 NOS1 2688/4885METAP2 4358/4885AXL 2738/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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